Base information
| Cat. No. | |
| CAS No. | 50870-61-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H7BrO |
| Molecular Weight | 175.023 |
| Exact Mass | 173.968 |
| XLogP3 | 2.0182 |
| Mr | 36.438 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 15 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=C1CCCC=C1Br |
